3-(9,9-dimethylfluoren-3-yl)-9-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6-[9-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6,6,14,14-tetramethyl-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaenyl]-1,3,5-triazin-2-yl]carbazole

C102H76N6 — CID 126632345

IUPAC3-(9,9-dimethylfluoren-3-yl)-9-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6-[9-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6,6,14,14-tetramethyl-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaenyl]-1,3,5-triazin-2-yl]carbazole
SMILESCC1(C)c2ccccc2-c2cc(-c3ccc4c(c3)c3ccccc3n4-c3cc4c5c(c3)C(C)(C)c3cc(-c6nc(-n7c8ccccc8c8cc(-c9ccc%10c(c9)-c9ccccc9C%10(C)C)ccc87)nc(-n7c8ccccc8c8cc(-c9ccc%10c(c9)-c9ccccc9C%10(C)C)ccc87)n6)cc(c3-5)C4(C)C)ccc21
InChIInChI=1S/C102H76N6/c1-98(2)77-29-17-11-23-65(77)71-47-57(35-41-80(71)98)60-38-44-90-74(50-60)68-26-14-20-32-87(68)106(90)64-55-85-94-86(56-64)102(9,10)84-54-63(53-83(93(84)94)101(85,7)8)95-103-96(107-88-33-21-15-27-69(88)75-51-61(39-45-91(75)107)58-36-42-81-72(48-58)66-24-12-18-30-78(66)99(81,3)4)105-97(104-95)108-89-34-22-16-28-70(89)76-52-62(40-46-92(76)108)59-37-43-82-73(49-59)67-25-13-19-31-79(67)100(82,5)6/h11-56H,1-10H3
InChIKeyJGOXAYKDSPQROQ-UHFFFAOYSA-N
MW1385.77 g/mol
LogP25.70
Rot. Bonds7

About 3-(9,9-dimethylfluoren-3-yl)-9-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6-[9-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6,6,14,14-tetramethyl-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaenyl]-1,3,5-triazin-2-yl]carbazole

3-(9,9-dimethylfluoren-3-yl)-9-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6-[9-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6,6,14,14-tetramethyl-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaenyl]-1,3,5-triazin-2-yl]carbazole (PubChem CID 126632345) has the molecular formula C102H76N6 and a molecular weight of 1385.77 g/mol. Its IUPAC name is 3-(9,9-dimethylfluoren-3-yl)-9-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6-[9-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6,6,14,14-tetramethyl-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaenyl]-1,3,5-triazin-2-yl]carbazole.

Molecular Properties

Compound Name3-(9,9-dimethylfluoren-3-yl)-9-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6-[9-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6,6,14,14-tetramethyl-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaenyl]-1,3,5-triazin-2-yl]carbazole
PubChem CID126632345
Molecular FormulaC102H76N6
Molecular Weight1385.77 g/mol
Exact Mass1384.61
IUPAC Name3-(9,9-dimethylfluoren-3-yl)-9-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6-[9-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6,6,14,14-tetramethyl-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaenyl]-1,3,5-triazin-2-yl]carbazole
SMILESCC1(C)c2ccccc2-c2cc(-c3ccc4c(c3)c3ccccc3n4-c3cc4c5c(c3)C(C)(C)c3cc(-c6nc(-n7c8ccccc8c8cc(-c9ccc%10c(c9)-c9ccccc9C%10(C)C)ccc87)nc(-n7c8ccccc8c8cc(-c9ccc%10c(c9)-c9ccccc9C%10(C)C)ccc87)n6)cc(c3-5)C4(C)C)ccc21
InChIInChI=1S/C102H76N6/c1-98(2)77-29-17-11-23-65(77)71-47-57(35-41-80(71)98)60-38-44-90-74(50-60)68-26-14-20-32-87(68)106(90)64-55-85-94-86(56-64)102(9,10)84-54-63(53-83(93(84)94)101(85,7)8)95-103-96(107-88-33-21-15-27-69(88)75-51-61(39-45-91(75)107)58-36-42-81-72(48-58)66-24-12-18-30-78(66)99(81,3)4)105-97(104-95)108-89-34-22-16-28-70(89)76-52-62(40-46-92(76)108)59-37-43-82-73(49-59)67-25-13-19-31-79(67)100(82,5)6/h11-56H,1-10H3
InChIKeyJGOXAYKDSPQROQ-UHFFFAOYSA-N
XLogP25.70
TPSA53.46 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms108
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001385.77
LogP ≤ 525.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 3-(9,9-dimethylfluoren-3-yl)-9-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6-[9-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6,6,14,14-tetramethyl-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaenyl]-1,3,5-triazin-2-yl]carbazole with MolForge

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Related Compounds

3-(9,9-dimethylfluoren-3-yl)-9-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6-[4-[4-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]phenyl]phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole
CID 126632340
3-(9,9-dimethylfluoren-3-yl)-9-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6-[7-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-9,9-diphenylfluoren-2-yl]-1,3,5-triazin-2-yl]carbazole
CID 126632338
3-[4-(9,9-dimethylfluoren-2-yl)-6-(3-phenylcarbazol-9-yl)-1,3,5-triazin-2-yl]-9-(4-methylphenyl)carbazole
CID 137401866
2,5-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazole;5,9-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole
CID 157062931
3-[9-[4-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]phenyl]carbazol-3-yl]-9-(9,9-dimethylfluoren-2-yl)-6-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]carbazole;9-(9,9-dimethylfluoren-2-yl)-3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-6-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]carbazole
CID 160991667
3-(9,9-dimethylfluoren-2-yl)-9-[3-[4-[3-(9,9-dimethylfluoren-2-yl)carbazol-9-yl]-6-(2,5-diphenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 134236850
3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole
CID 58511641
9-[2,4-bis[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]quinazolin-6-yl]-3-(9,9-dimethylfluoren-3-yl)carbazole
CID 126632325
3-(9,9-dimethylfluoren-2-yl)-9-[3-[4-[3-(9,9-dimethylfluoren-2-yl)carbazol-9-yl]-6-[3-(3,5-diphenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole
CID 134236852
9-[4-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenylcarbazole
CID 158012983
9-[4-carbazol-9-yl-6-(23,23-dimethyl-19-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaenyl)-1,3,5-triazin-2-yl]carbazole
CID 121450167
9-[4-(9,9-dimethylfluoren-2-yl)-6-(2-phenylcarbazol-9-yl)-1,3,5-triazin-2-yl]-2,7-diphenylcarbazole
CID 168742742

Frequently Asked Questions

What is the IUPAC name of 3-(9,9-dimethylfluoren-3-yl)-9-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6-[9-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6,6,14,14-tetramethyl-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaenyl]-1,3,5-triazin-2-yl]carbazole?
The IUPAC name of 3-(9,9-dimethylfluoren-3-yl)-9-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6-[9-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6,6,14,14-tetramethyl-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaenyl]-1,3,5-triazin-2-yl]carbazole (CID 126632345) is 3-(9,9-dimethylfluoren-3-yl)-9-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6-[9-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6,6,14,14-tetramethyl-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaenyl]-1,3,5-triazin-2-yl]carbazole.
What is the SMILES notation for 3-(9,9-dimethylfluoren-3-yl)-9-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6-[9-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6,6,14,14-tetramethyl-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaenyl]-1,3,5-triazin-2-yl]carbazole?
The canonical SMILES for 3-(9,9-dimethylfluoren-3-yl)-9-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6-[9-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6,6,14,14-tetramethyl-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaenyl]-1,3,5-triazin-2-yl]carbazole is CC1(C)c2ccccc2-c2cc(-c3ccc4c(c3)c3ccccc3n4-c3cc4c5c(c3)C(C)(C)c3cc(-c6nc(-n7c8ccccc8c8cc(-c9ccc%10c(c9)-c9ccccc9C%10(C)C)ccc87)nc(-n7c8ccccc8c8cc(-c9ccc%10c(c9)-c9ccccc9C%10(C)C)ccc87)n6)cc(c3-5)C4(C)C)ccc21.
What is the InChIKey of 3-(9,9-dimethylfluoren-3-yl)-9-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6-[9-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6,6,14,14-tetramethyl-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaenyl]-1,3,5-triazin-2-yl]carbazole?
The InChIKey is JGOXAYKDSPQROQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C102H76N6/c1-98(2)77-29-17-11-23-65(77)71-47-57(35-41-80(71)98)60-38-44-90-74(50-60)68-26-14-20-32-87(68)106(90)64-55-85-94-86(56-64)102(9,10)84-54-63(53-83(93(84)94)101(85,7)8)95-103-96(107-88-33-21-15-27-69(88)75-51-61(39-45-91(75)107)58-36-42-81-72(48-58)66-24-12-18-30-78(66)99(81,3)4)105-97(104-95)108-89-34-22-16-28-70(89)76-52-62(40-46-92(76)108)59-37-43-82-73(49-59)67-25-13-19-31-79(67)100(82,5)6/h11-56H,1-10H3.
What are the key properties of 3-(9,9-dimethylfluoren-3-yl)-9-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6-[9-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6,6,14,14-tetramethyl-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaenyl]-1,3,5-triazin-2-yl]carbazole?
3-(9,9-dimethylfluoren-3-yl)-9-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6-[9-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6,6,14,14-tetramethyl-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaenyl]-1,3,5-triazin-2-yl]carbazole has a molecular weight of 1385.77 g/mol, XLogP of 25.70, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(9,9-dimethylfluoren-3-yl)-9-[4-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6-[9-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-6,6,14,14-tetramethyl-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaenyl]-1,3,5-triazin-2-yl]carbazole is sourced from PubChem (CID 126632345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).